(Q105018035)

English

(1R,3aR,5aR,5bR,7aS,11aR,11bR,13aS,13bS)-1-(2-hydroxypropan-2-yl)-3a,5a,5b,8,8,11a-hexamethyl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysen-9-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

1-(2-hydroxypropan-2-yl)-3a,5a,5b,8,8,11a-hexamethyl-tetradecahydro-1H-cyclopenta[a]chrysen-9-one

1 reference

based on heuristic

inferred from SMILES

mass

442.38108084 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

20-Hydroxylupan-3-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₀H₅₀O₂

0 references

canonical SMILES

O=C1CCC2(C)C(CCC3(C)C2CCC4C5C(CCC5(C)CCC43C)C(O)(C)C)C1(C)C

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isomeric SMILES

CC1(C)C(=O)CC[C@@]2(C)[C@@H]1CC[C@]1(C)[C@@H]2CC[C@H]2[C@H]3[C@H](C(C)(C)O)CC[C@]3(C)CC[C@]21C

0 references

found in taxon

Vellozia nanuzae

1 reference

stated in

Diterpenes from Vellozia nanuzae

Identifiers

InChI

InChI=1S/C30H50O2/c1-25(2)21-12-16-30(8)22(28(21,6)15-13-23(25)31)10-9-20-24-19(26(3,4)32)11-14-27(24,5)17-18-29(20,30)7/h19-22,24,32H,9-18H2,1-8H3/t19-,20+,21-,22-,24-,27-,28+,29-,30-/m1/s1

0 references

InChIKey

GSWAYWHLZGLNSD-NVZUAYPLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GSWAYWHLZGLNSD-NVZUAYPLSA-N

(Q105018035)

(1R,3aR,5aR,5bR,7aS,11aR,11bR,13aS,13bS)-1-(2-hydroxypropan-2-yl)-3a,5a,5b,8,8,11a-hexamethyl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysen-9-one

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