Chem
J-GLOBAL ID:200907048896889667   Nikkaji number:J38.826B

Hopenone a

ホペノンa
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C30H48O
Molecular formula furigana: C30-H48-O
Molecular weight: 424.713
InChI: InChI=1S/C30H48O/c1-19(2)20-11-15-27(5)21(20)12-17-29(7)23(27)9-10-24-28(6)16-14-25(31)26(3,4)22(28)13-18-30(24,29)8/h21-24H,9-18H2,1-8H3/t21-,22-,23+,24+,27+,28-,29+,30+/m0/s1
InChI key: NTZCFZIEUJGSQA-XJNUBZBUSA-N
SMILES: CC(=C1CC[C@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC[C@@H]2[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]12C)C
Systematic name  (3):
  • 5α-ホパ-21-エン-3-オン
  • (3aR,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-5a,5b,8,8,11a,13b-ヘキサメチル-3-(プロパン-2-イリデン)-イコサヒドロ-1H-シクロペンタ[a]クリセン-9-オン
  • (3aR,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-5a,5b,8,8,11a,13b-hexamethyl-3-(propan-2-ylidene)-icosahydro-1H-cyclopenta[a]chrysen-9-one
Other name (3):
  • ホペノンa
  • Hopenone a
  • 5α-Hop-21-en-3-one
CAS registry number: 17152-56-6
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