Chem
J-GLOBAL ID:201607018326689957
Nikkaji number:J3.486.737B
(12R)-7α,12-Methano-5β,8β-ethano-13,13-dimethoxy-6α,10α-dihydroxy-20-norpodocarpane-14-one
(12R)-7α,12-メタノ-5β,8β-エタノ-13,13-ジメトキシ-6α,10α-ジヒドロキシ-20-ノルポドカルパン-14-オン
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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:
C21 H32 O5
Molecular formula furigana:
C21-H32-O5
Molecular weight:
364.482
InChI:
InChI=1S/C21H32O5/c1-17(2)6-5-7-20(24)14-11-12-10-13-15(22)19(17,20)9-8-18(13,14)16(23)21(12,25-3)26-4/h12-15,22,24H,5-11H2,1-4H3/t12-,13-,14+,15+,18-,19-,20-/m1/s1
InChI key:
HPBZWSDHPVSSMC-SROPKWAUSA-N
SMILES:
COC1(OC)[C@@H]2C[C@@H]3[C@H](O)[C@@]45CC[C@@]3([C@H](C2)[C@]4(O)CCCC5(C)C)C1=O
Systematic name (3):
(12R)-7α,12-メタノ-5β,8β-エタノ-13,13-ジメトキシ-6α,10α-ジヒドロキシ-20-ノルポドカルパン-14-オン
(1R,2S,3R,8S,9S,10S,12R)-3,9-ジヒドロキシ-13,13-ジメトキシ-7,7-ジメチルペンタシクロ[6.6.2.12,12 .01,10 .03,8 ]ヘプタデカン-14-オン
(1R,2S,3R,8S,9S,10S,12R)-3,9-dihydroxy-13,13-dimethoxy-7,7-dimethylpentacyclo[6.6.2.12,12 .01,10 .03,8 ]heptadecan-14-one
Other name (1):
(12R)-7α,12-Methano-5β,8β-ethano-13,13-dimethoxy-6α,10α-dihydroxy-20-norpodocarpane-14-one
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