(Q105262616)

English

(1R,3aR,5aR,5bR,7aS,9R,11R,11aR,11bS,13aR,13bS)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol

chemical compound

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instance of

type of chemical entity

0 references

1 reference

442.38108084 dalton

1 reference

2 references

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,3aS,5aR,5bR,7aR,9S,11R,11aS,11bS,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

20(29)-lupene-1beta,3beta-diol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

20(29)-lupene-1beta,3alpha-diol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,3aS,5aR,5bR,7aR,9R,11R,11aS,11bS,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol

1 reference

1 reference

(1R,3aR,5aR,5bR,7aS,9S,11R,11aR,11bS,13aR,13bS)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₅₀O₂

0 references

canonical SMILES

OC1CC(O)C2(C)C(CCC3(C)C2CCC4C5C(C(=C)C)CCC5(C)CCC43C)C1(C)C

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isomeric SMILES

C=C(C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@]5(C)[C@@H](CC[C@]43C)C(C)(C)[C@H](O)C[C@H]5O)[C@H]12

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found in taxon

Glochidion puberum

1 reference

stated in

Triterpenoids from Glochidion macrophyllum and G. puberum

Phyllanthus puberus

1 reference

stated in

Triterpenoids from Glochidion macrophyllum and G. puberum

Monteverdia cuzcoina

1 reference

stated in

Lupane triterpenoids from Maytenus species

Phyllanthus multilocularis

1 reference

stated in

Chemical constituents of glochidion hohenackeri

Identifiers

InChI

InChI=1S/C30H50O2/c1-18(2)19-11-13-27(5)15-16-28(6)20(25(19)27)9-10-22-29(28,7)14-12-21-26(3,4)23(31)17-24(32)30(21,22)8/h19-25,31-32H,1,9-17H2,2-8H3/t19-,20+,21-,22-,23+,24+,25-,27+,28+,29+,30-/m0/s1

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InChIKey

SWEUJTWPRYKNNX-KVOAGRBPSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105262616)

(1R,3aR,5aR,5bR,7aS,9R,11R,11aR,11bS,13aR,13bS)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol

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Identifiers

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