Chem
J-GLOBAL ID:200907017886909330
Nikkaji number:J185.522K
Fruticin A
フルチシンA
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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:
C30 H48 O4
Molecular formula furigana:
C30-H48-O4
Molecular weight:
472.710
InChI:
InChI=1S/C30H48O4/c1-25(2)21-10-9-19-18(27(21,5)14-12-22(25)32)11-15-28(6)24(20(31)17-29(19,28)7)30(8)16-13-23(33)26(3,4)34-30/h20-21,23-24,31,33H,9-17H2,1-8H3/t20-,21-,23-,24-,27+,28+,29-,30+/m0/s1
InChI key:
UOJZDCZJUDQILX-NIJUVOBCSA-N
SMILES:
C[C@]12CCC3=C(CC[C@H]4C(C)(C)C(=O)CC[C@]34C)[C@]1(C)C[C@H](O)[C@@H]2[C@@]1(C)CC[C@H](O)C(C)(C)O1
Systematic name (4):
(+)-16β-ヒドロキシ-17β-[(2R)-テトラヒドロ-5α-ヒドロキシ-2,6,6-トリメチル-2H-ピラン-2β-イル]-4,4,14-トリメチル-5α-アンドロスタ-8-エン-3-オン
[20R,24S,(+)]-20,25-エポキシ-16β,24-ジヒドロキシラノスタ-8-エン-3-オン
(1R,2S,3aR,5aR,9aS,11aR)-2-ヒドロキシ-1-[(2R,5S)-5-ヒドロキシ-2,6,6-トリメチルオキサン-2-イル]-3a,6,6,9a,11a-ペンタメチル-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オン
(1R,2S,3aR,5aR,9aS,11aR)-2-hydroxy-1-[(2R,5S)-5-hydroxy-2,6,6-trimethyloxan-2-yl]-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (8):
(+)-フルチシンA
フルチシンA
Fruticin A
(+)-Fruticin A
[20R,24S,(+)]-20,25-Epoxy-16β,24-dihydroxylanost-8-en-3-one
(+)-16β-Hydroxy-17β-[(2R)-tetrahydro-5α-hydroxy-2,6,6-trimethyl-2H-pyran-2β-yl]-4,4,14-trimethyl-5α-androst-8-en-3-one
(+)-16β-Hydroxy-17β-[(2R)-tetrahydro-5α-hydroxy-2,6,6-trimethyl-2H-pyran-2β-yl]-4,4,14-trimethyl-5α-androsta-8-ene-3-one
[20R,24S,(+)]-20,25-Epoxy-16β,24-dihydroxylanosta-8-ene-3-one
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CAS registry number:
96888-52-7
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