(Q105113452)

English

(2R)-2-[(3S,3aS,5aR,5bR,7aS,11aS,11bR,13aS,13bR)-13b-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-3-yl]propan-1-ol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

2-[13b-(Hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-3-yl]propan-1-ol

1 reference

based on heuristic

inferred from SMILES

mass

444.396730904 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₅₂O₂

0 references

canonical SMILES

OCC(C)C1CCC2(CO)C1CCC3(C)C2CCC4C5(C)CCCC(C)(C)C5CCC43C

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isomeric SMILES

C[C@@H](CO)[C@H]1CC[C@@]2(CO)[C@H]1CC[C@]1(C)[C@@H]2CC[C@@H]2[C@@]3(C)CCCC(C)(C)[C@@H]3CC[C@]21C

0 references

found in taxon

Lady Gagae

1 reference

stated in

Leaf surface terpenoids of the tree fernLophosoria quadripinnata

Identifiers

InChI

InChI=1S/C30H52O2/c1-20(18-31)21-10-17-30(19-32)22(21)11-15-29(6)25(30)9-8-24-27(4)14-7-13-26(2,3)23(27)12-16-28(24,29)5/h20-25,31-32H,7-19H2,1-6H3/t20-,21+,22-,23-,24+,25-,27-,28+,29+,30+/m0/s1

0 references

InChIKey

IIGGBARDSBQECF-MKDCHBEHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IIGGBARDSBQECF-MKDCHBEHSA-N

(Q105113452)

(2R)-2-[(3S,3aS,5aR,5bR,7aS,11aS,11bR,13aS,13bR)-13b-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-3-yl]propan-1-ol

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Identifiers

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