ID: 42295
SMILES:Oc1c(CCCC)c(O)c2c(c1C(OC)=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.358
InChIKey:CEOMMJHZLXRRPG-UHFFFAOYSA-N
ID: 42296
SMILES:C12C(C)=CCC1C(C)(C)Oc1cc(CCCCC)c(C(OC)=O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.948
InChIKey:VMHRLHZEWYIQMK-UHFFFAOYSA-N
ID: 42297
SMILES:O(c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.286
InChIKey:VBGLQLUQKZRKHZ-UHFFFAOYSA-N
ID: 42298
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 42299
SMILES:CC(C)=CCc1c2c(ccc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.712
InChIKey:MBQCVNQREXBGBQ-UHFFFAOYSA-N
ID: 42300
SMILES:O=C1CC(C)(C)Oc2c1c(OC)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.39
InChIKey:OSPHQBHEZGPNMT-UHFFFAOYSA-N
ID: 42301
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(O)c3)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.284
InChIKey:JIQMEMDNHUCIPK-UHFFFAOYSA-N
ID: 42302
SMILES:c1(CCCCC)cc(O)c(CC=C(C(CC=C(C)C)O)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.334
InChIKey:PXMMOISCSOLPFY-UHFFFAOYSA-N
ID: 42303
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(COC(=O)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 42304
SMILES:C(CCCC(C)=Cc1c(O)c2c(c3c1OC(=O)C3)OC(CCC=C(C)C)(C)C1C2C=C(C)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.7
CB1 binding score: -16.057
InChIKey:WHRPAPRVHAIIDN-UHFFFAOYSA-N
ID: 42305
SMILES:c1(CCCCC)cc2c(c(O)c1)C1=C(C(C)(C)O2)C2=C3C4C(C)(C(O)CC4=C(C)C2CC1)C(=O)C1C(C1(C)C)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.76
CB1 binding score: -12.577
InChIKey:HWGFTRGGZONIMW-UHFFFAOYSA-N
ID: 42306
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.427
InChIKey:UTXVBEHMQGNODO-UHFFFAOYSA-N
ID: 42307
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C1(C)CCC2C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.819
InChIKey:KAMBAVCQZNPQOI-UHFFFAOYSA-N
ID: 42308
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.281
InChIKey:KZTIITBECKQIPO-UHFFFAOYSA-N
ID: 42309
SMILES:C1(C)CCC2C(C)(C)Oc3cc(CO)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.776
InChIKey:RISKOFGQEFJODU-UHFFFAOYSA-N
ID: 42310
SMILES:C1C2=CC(O)(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1C(COC(=O)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -12.799
InChIKey:FYZGBWMIJALQNO-UHFFFAOYSA-N
ID: 42311
SMILES:O(c1cc2c(cc1O)C1CC(C)=CCC1C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.716
InChIKey:HINHHDLHKOVMSS-UHFFFAOYSA-N
ID: 42312
SMILES:C(CO)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)C(OC(=O)C)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.07
InChIKey:UDGXRQNCXDSSDA-UHFFFAOYSA-N
ID: 42313
SMILES:C(C=C)(c1c(O)cc(C)c2c1OC(C)(C)C(OCC)C2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.379
InChIKey:SSFLOGWRFZBHBO-UHFFFAOYSA-N
ID: 42314
SMILES:C(=Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.667
InChIKey:DDBMDRDKHRVEAX-UHFFFAOYSA-N
ID: 42315
SMILES:C1CC2(C)c3c(CC(C)(C)OC)cc(O)cc3COC2=C(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.088
InChIKey:GOCQEDJIDYQATA-UHFFFAOYSA-N