Chem
J-GLOBAL ID:200907041498849260
Nikkaji number:J2.190.255A
N-(β-D-Galactopyranosyl)carbamic acid (4S)-3,14-dioxo-4-ethyl-4,12-dihydro-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-4β-yl ester
N-(β-D-ガラクトピラノシル)カルバミド酸(4S)-3,14-ジオキソ-4-エチル-4,12-ジヒドロ-1H-ピラノ[3′,4′:6,7]インドリジノ[1,2-b]キノリン-4β-イル
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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:
C27 H27 N3 O10
Molecular formula furigana:
C27-H27-N3-O10
Molecular weight:
553.524
InChI:
InChI=1S/C27H27N3O10/c1-2-27(40-26(37)29-23-22(34)21(33)20(32)18(10-31)39-23)15-8-17-19-13(7-12-5-3-4-6-16(12)28-19)9-30(17)24(35)14(15)11-38-25(27)36/h3-8,18,20-23,31-34H,2,9-11H2,1H3,(H,29,37)/t18-,20+,21+,22-,23-,27+/m1/s1
InChI key:
WRBWPFTTYDJIID-RDUQXNQGSA-N
SMILES:
CC[C@@]1(OC(=O)N[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(=O)OCc2c1cc1c3nc4ccccc4cc3Cn1c2=O
Systematic name (3):
N-(β-D-ガラクトピラノシル)カルバミド酸(4S)-3,14-ジオキソ-4-エチル-4,12-ジヒドロ-1H-ピラノ[3′,4′:6,7]インドリジノ[1,2-b]キノリン-4β-イル
(19S)-19-エチル-14,18-ジオキソ-17-オキサ-3,13-ジアザペンタシクロ[11.8.0.02,11 .04,9 .015,20 ]ヘンイコサ-1(21),2(11),3,5,7,9,15(20)-ヘプタエン-19-イル N-[(2R,3R,4S,5R,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]カルバマート
(19S)-19-ethyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11 .04,9 .015,20 ]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-19-yl N-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]carbamate
Other name (1):
N-(β-D-Galactopyranosyl)carbamic acid (4S)-3,14-dioxo-4-ethyl-4,12-dihydro-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-4β-yl ester
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