(2S,3S,4R,5R,6R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[(2S,3R,4R,5S)-3-acetamido-4-hydroxy-6-methyl-5-[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2-hydroxy-5-oxocyclopenten-1-yl)carbamoyl]oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4-carbamoyloxy-6-[[(2R)-2-carboxy-2-[(2E,6E,13E)-3,8,8,14,18-pentamethyl-11-methylidenenonadeca-2,6,13,17-tetraenoxy]ethoxy]-hydroxyphosphoryl]oxy-3-hydroxy-3-methyloxane-2-carboxylic acid（CAS号：11015-37-5）

黄霉素

基本信息

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CAS号

11015-37-5

分子式

C69H107N4O35P

分子量

1583.6 g/mol

化学分类

基础化工原料有机化学品羧酸类

基础化工原料有机化学品酮类

基础化工原料有机化学品醚类

基础化工原料有机化学品胺类

基础化工原料有机化学品杂环化合物

医药化工医药中间体杂环中间体

精细化工产品表面活性剂阴离子表面活性剂

农用化学品农药杀虫剂

聚合物和塑料热塑性塑料聚烯烃

实验室化学品科研化学品生化试剂

基本物理性质

密度

1.47

折射率

1.615

SMILES

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CC1C(C(C(C(O1)OC2C(OC(C(C2O)NC(=O)C)OC3C(C(C(OC3OP(=O)(O)OCC(C(=O)O)OCC=C(C)CCC=CC(C)(C)CCC(=C)CC=C(C)CCC=C(C)C)C(=O)O)(C)O)OC(=O)N)COC4C(C(C(C(O4)CO)O)O)O)NC(=O)C)O)OC5C(C(C(C(O5)C(=O)NC6=C(CCC6=O)O)O)O)O

InChI

InChI=1S/C69H107N4O35P/c1-30(2)15-14-17-31(3)18-19-33(5)22-25-68(9,10)24-13-12-16-32(4)23-26-96-41(60(88)89)29-98-109(94,95)108-66-56(57(107-67(70)92)69(11,93)58(106-66)61(90)91)105-63-44(72-36(8)76)47(81)54(40(101-63)28-97-64-51(85)48(82)45(79)39(27-74)100-64)103-62-43(71-35(7)75)46(80)53(34(6)99-62)102-65-52(86)49(83)50(84)55(104-65)59(87)73-42-37(77)20-21-38(42)78/h13,15,18,23-24,34,39-41,43-58,62-66,74,77,79-86,93H,5,12,14,16-17,19-22,25-29H2,1-4,6-11H3,(H2,70,92)(H,71,75)(H,72,76)(H,73,87)(H,88,89)(H,90,91)(H,94,95)/b24-13+,31-18+,32-23+/t34?,39-,40-,41-,43-,44-,45-,46-,47-,48+,49+,50-,51-,52-,53-,54-,55+,56-,57-,58-,62+,63+,64-,65-,66-,69+/m1/s1

InChIKey

PERZMHJGZKHNGU-XIGAONJHSA-N

LogP

-1.4284000000000057

拓扑极性表面积

601.8800000000001 Å²

氢键供体/受体

19 / 39

复杂度

3370

安全信息

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GHS危险象形图

H413

危险说明

H413 可能对水生生物造成长期持续有害影响
危害水生环境-长期危害

毒性

LD50 in mice (mg/kg): >2000 orally, s.c. and i.p.; 1400 i.v. (Lindner, Wallhuser)

同义词与引用数据

英文

Flavomycin
Moenomycin Complex (>80%) (Mixture of Moenomycin A, Moenomycin A12, Moenomycin C1, Moenomycin C3, Moenomycin C4)
Flavophospholipol
(2S,3S,4R,5R,6R)-5-(((2S,3R,4R,5S,6R)-3-Acetamido-5-(((2S,3R,4R,5S)-3-acetamido-4-hydroxy-6-methyl-5-(((2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-((2-hydroxy-5-oxocyc
Moenomycin Complex (~5-10% Over CaCO3)
AC-37087
MFCD01742468
11015-37-5
KS-5173
AKOS016339637
MOENOMYCIN
moenomycin a
menomycin
BAMBERMYCIN
BAMBERMYCINS
flavophospholipol
Flavomycin Premix
Moenomycin Complex
Bambermycine
Moenomycine
YUHUNJI
Flavomycine