脱乙酰氧基文多灵

脱乙酰氧基文多灵
	IUPAC名; Methyl 3-hydroxy-16-methoxy-1-methyl-6,7-didehydro-2β,5α,12β,19α-aspidospermidine-3β-carboxylate
	系统名; Methyl (3aR,3a1S,5R,5aR,10bR)-3a-ethyl-5-hydroxy-8-methoxy-6-methyl-3a,3a1,4,5,5a,6,11,12-octahydro-1H-indolizino[8,1-cd]carbazole-5-carboxylate
别名	Deacetoxyvindoline
识别
CAS号	105119-60-6 [[1]]
PubChem	439783
ChemSpider	388838
SMILES	CC[C@]12C[C@@]([C@H]3[C@@]4([C@H]1N(CC4)CC=C2)c5ccc(cc5N3C)OC)(C(=O)OC)O;
InChI	1/C23H30N2O4/c1-5-21-9-6-11-25-12-10-22(18(21)25)16-8-7-15(28-3)13-17(16)24(2)19(22)23(27,14-21)20(26)29-4/h6-9,13,18-19,27H,5,10-12,14H2,1-4H3/t18-,19+,21-,22+,23+/m0/s1;
InChIKey	WNKDGPXNFMMOEJ-RNJSZURPBV
ChEBI	16957
KEGG	C02673
性质
化学式	C23H30N2O4
摩尔质量	398.5 g·mol−1
	若非注明，所有数据均出自标准状态（25 ℃，100 kPa）下。

脱乙酰氧基文多灵（英語：Desacetoxyvindoline）是一种有机化合物，分子式C₂₃H₃₀N₂O₄，属于吲哚生物碱，存在于長春花（Catharanthus roseus）等植物中，由3-羟基-16-甲氧基-2,3-二氢水甘草碱生成^[2]，再羟基化为脱乙酰基文多灵^[3]。

参考文献

^ KNApSAcK Metabolite Information - C00051787. www.knapsackfamily.com.
^ Liscombe, DK; Usera, AR; O'Connor, SE. Homolog of tocopherol C methyltransferases catalyzes N methylation in anticancer alkaloid biosynthesis.. Proceedings of the National Academy of Sciences of the United States of America. 2 November 2010, 107 (44): 18793–8. Bibcode:2010PNAS..10718793L. PMC 2973921  . PMID 20956330. doi:10.1073/pnas.1009003107  .
^ Vazquez-Flota, Felipe; De Carolis, Emidio; Alarco, Anne-Marie; De Luca, Vincenzo. Molecular cloning and characterization of desacetoxyvindoline-4-hydroxylase, a 2-oxoglutarate dependent-dioxygenase involved in the biosynthesis of vindoline in Catharanthus roseus (L.) G. Don. Plant Molecular Biology. 1997, 34 (6): 935–948. PMID 9290645. S2CID 33942703. doi:10.1023/A:1005894001516.

脱乙酰氧基文多灵

IUPAC名 Methyl 3-hydroxy-16-methoxy-1-methyl-6,7-didehydro-2β,5α,12β,19α-aspidospermidine-3β-carboxylate
系统名 Methyl (3aR,3a¹S,5R,5aR,10bR)-3a-ethyl-5-hydroxy-8-methoxy-6-methyl-3a,3a¹,4,5,5a,6,11,12-octahydro-1H-indolizino[8,1-cd]carbazole-5-carboxylate
别名	Deacetoxyvindoline
识别
CAS号	105119-60-6 ^N[[1]]
PubChem	439783
ChemSpider	388838
SMILES	CC[C@]12C[C@@]([C@H]3[C@@]4([C@H]1N(CC4)CC=C2)c5ccc(cc5N3C)OC)(C(=O)OC)O
InChI	1/C23H30N2O4/c1-5-21-9-6-11-25-12-10-22(18(21)25)16-8-7-15(28-3)13-17(16)24(2)19(22)23(27,14-21)20(26)29-4/h6-9,13,18-19,27H,5,10-12,14H2,1-4H3/t18-,19+,21-,22+,23+/m0/s1
InChIKey	WNKDGPXNFMMOEJ-RNJSZURPBV
ChEBI	16957
KEGG	C02673
性质
化学式	C₂₃H₃₀N₂O₄
摩尔质量	398.5 g·mol⁻¹
若非注明，所有数据均出自标准状态（25 ℃，100 kPa）下。