ID: 43072
SMILES:C1(C)Oc2cc(CCCCC)cc(OC3C(O)C(O)C(O)C(CO)O3)c2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.453
CB1 binding score: -1.306
InChIKey:BDOKFALYZBKIHK-UHFFFAOYSA-N
ID: 43073
SMILES:CC(=CCc1c(O)c2c(c(-c3ccccc3C)c1O)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.577
CB1 binding score: -16.079
InChIKey:ORLFKPCIRZMMJX-UHFFFAOYSA-N
ID: 43074
SMILES:C1=C(C)CCC2C(C)(C)Oc3c4c(c(CC(O)CC)cc3OC12)OCO4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.678
InChIKey:HRIFFEVXFKJSHP-UHFFFAOYSA-N
ID: 43075
SMILES:c1(O)cc(O)cc2cc3c(c(O)c12)C(CC1C(C)(CCO)Oc2c(CCC(O)=O)c(O)c4c(c21)OC(C)(C)C1CCC(C)=CC14)OC(C)(C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 688.814
CB1 binding score: -16.015
InChIKey:YISVIMIQBPRZJI-UHFFFAOYSA-N
ID: 43076
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(O)=O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 43077
SMILES:CC(C1CCC(C(OC)=O)=CC1c1c(O)cc(CCCCC)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.3
InChIKey:LPZAVXXYHUHMIC-UHFFFAOYSA-N
ID: 43078
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 43079
SMILES:Cc1c2c3c(c(C)c(C(C)=O)c(O)c3)OC(C)(C)C(CCC(C)=CC1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -16.635
InChIKey:HWKKVDGAPDODQG-UHFFFAOYSA-N
ID: 43080
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC(O)C(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N
ID: 43081
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 43082
SMILES:CC1C2C(c3c(cc(CCCCC)cc3O)OC2(C(C)C)O)CC2(C)C(O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.659
InChIKey:UEQKDEOIDLIKCF-UHFFFAOYSA-N
ID: 43083
SMILES:c1(O)c2c(c(C(=O)C(C)CC)c(O)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 43084
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c3C1CO)C=C(C(CCC=C(C)C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -14.404
InChIKey:UDUWWWZKVWFUTH-UHFFFAOYSA-N
ID: 43085
SMILES:COc1c(OC)c(CCCC)c2c(c1)OC(C)(C)C1OC(=O)C(=CC)C1C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -13.021
InChIKey:AOZVJMFBQODFAV-UHFFFAOYSA-N
ID: 43086
SMILES:C(C)(=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 43087
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(=O)C2=C(C1=O)CCCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -13.424
InChIKey:SZXLXYHHZFKAAO-UHFFFAOYSA-N
ID: 43088
SMILES:C(c1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.585
InChIKey:DNTBFILTGOCICF-UHFFFAOYSA-N
ID: 43089
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 43090
SMILES:C1(C(=C)C)C2c3c(cc(CCCCC)cc3O1)OC(C=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.991
InChIKey:GXMVGJKLIGWSLP-UHFFFAOYSA-N
ID: 43091
SMILES:C1(C)(C(O)=CC(CC(C)CCCc2ccccc2)O)Oc2c(C)cc(O)cc2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -14.487
InChIKey:CCAMAJSRBGWYID-UHFFFAOYSA-N
ID: 43092
SMILES:CC1(C)C=CCC2(C)C(CO)Oc3c(c(O)cc(CCCC)c31)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.288
InChIKey:YRSQDNSPTGXXFW-UHFFFAOYSA-N