(Q105000732)

English

(3S,4aS,6aS,6bS,8aR,11S,12R,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

chemical compound

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1 reference

(3S,6aR,6bS,8aR,11R,12S,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

1 reference

1 reference

426.38616622 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,4aS,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3R,4aR,6aR,6bS,8aR,11R,12R,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,4aR,6aS,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3R,4aS,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3R,4aR,6aR,6bR,8aR,11S,12S,12aS,14aS,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

1 reference

based on heuristic

inferred from InChI

(3S,4aR,6aR,6bS,8aR,11S,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

1 reference

based on heuristic

inferred from InChI

(3S,4aS,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

1 reference

based on heuristic

inferred from InChI

(3R,4aR,6aR,6bS,8aR,11R,12R,12aS,14aR,14bS)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

1 reference

1 reference

(3S,4aR,6aR,6bR,8aR,11S,12S,12aS,14aS,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

1 reference

based on heuristic

inferred from InChI

(3S,4aR,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

1 reference

based on heuristic

inferred from InChI

(3R,4aR,6aR,6bS,8aS,11S,12R,12aS,14aR,14bS)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₅₀O

0 references

canonical SMILES

OC1CCC2(C)C(CCC3(C)C2CC=C4C5C(C)C(C)CCC5(C)CCC43C)C1(C)C

0 references

isomeric SMILES

C[C@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@H]4[C@]3(C)CC[C@@H]3C(C)(C)[C@@H](O)CC[C@@]34C)[C@H]2[C@@H]1C

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found in taxon

Adenia cissampeloides

1 reference

stated in

Crystalline principles from the leaves and twigs of Leptadenia reticulata

Blainvillea acmella

1 reference

stated in

Triterpenoid and sterol constituents of Blainvillea latifolia

Pyrus pashia

1 reference

stated in

Chemical constituents of Actinodaphne augustifolia, Croton sparsiflorus, Duabanga sonneratiodes, Glycosmis mauritiana, Hedyotis auricularia, Lyonia ovalifolia, Micromelum pubescens, Pyrus pashia and Rhododendron niveum

Rhododendron niveum

1 reference

stated in

Constituents of Colocasia formicata, Sagittaria sagittifloria, Arnebia nobilis, Ipomoea paniculata rhododendron niveum, Paspalum scrobiculatum, Mundulea sericea and Duabanga sonneratiodes

Rubus fruticosus

1 reference

stated in

Sterols and triterpenes from Rubus fruticosus

Rubus plicatus

1 reference

stated in

Sterols and triterpenes from Rubus fruticosus

Wisteria floribunda

1 reference

stated in

Studies on Constituents of Medicinal Plants. XV. The Constituents of the Bark and Wood of Wisteria floribunda DC

Spilanthes acmella

1 reference

stated in

Triterpenoid and sterol constituents of Blainvillea latifolia

Rubus cochinchinensis

1 reference

stated in

Sterols and triterpenes from Rubus fruticosus

Identifiers

InChI

InChI=1S/C30H50O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9,19-20,22-25,31H,10-18H2,1-8H3/t19-,20+,22+,23+,24-,25+,27+,28-,29+,30-/m0/s1

0 references

InChIKey

FSLPMRQHCOLESF-FGVRYQJISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FSLPMRQHCOLESF-FGVRYQJISA-N

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