ID: 31354
SMILES:C1CC2(C(C)CC(=O)C(C(CC(=O)NCCNCCC)C)=C2O)Oc2c1c(O)c(C(=O)O)c(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 544.689
CB1 binding score: Not available
InChIKey:KPOOJHMERRZJOK-UHFFFAOYSA-N
ID: 31355
SMILES:CC1(O)CC(C=C(C)C=O)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -13.305
InChIKey:ZCDABKVSFGILQZ-UHFFFAOYSA-N
ID: 31356
SMILES:Oc1c2c(cc(OC)c1CC=C(C)CCC=C(C)CC=CC(O)(C)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.716
CB1 binding score: -15.413
InChIKey:ONFCWAWTOFJICW-UHFFFAOYSA-N
ID: 31357
SMILES:OC1C2(C)CCCC(C(C)=C)C2c2c(cc(CCCCC)c(C(O)=O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -16.502
InChIKey:AQCDBJFJKKKFLM-UHFFFAOYSA-N
ID: 31358
SMILES:C(CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 31359
SMILES:c1(O)c(OC)cc2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.792
InChIKey:PTRUQZFKQPKEPN-UHFFFAOYSA-N
ID: 31360
SMILES:C1(C)=CCCC(C)=CCCC2(C)Oc3cc(CCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.737
InChIKey:AIKUYLIPEZBDHT-UHFFFAOYSA-N
ID: 31361
SMILES:COc1cc(C)cc(OC(CCC)=O)c1C1(C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.892
InChIKey:BFIPEMPPKACKDZ-UHFFFAOYSA-N
ID: 31362
SMILES:C1(C(C)=C)C(c2c(C)cc(O)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 31363
SMILES:c12c(c(OC(C)=O)cc(CCC(O)CC)c1)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -15.9
InChIKey:PCYVJGBDSHKLGT-UHFFFAOYSA-N
ID: 31364
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -17.812
InChIKey:MGEGNKXUIQHAJB-UHFFFAOYSA-N
ID: 31365
SMILES:N(C=O)C1CC(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.494
CB1 binding score: -11.69
InChIKey:NTHPXGNPFVDCEA-UHFFFAOYSA-N
ID: 31366
SMILES:C12(C)C(C(OC(=O)C)C3C1c1c(cc(CCCCC)cc1O)O3)C(C)C(=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -16.181
InChIKey:UMDLPSXCNOXVBG-UHFFFAOYSA-N
ID: 31367
SMILES:C12CC(C)=CC(=O)C1C(C)(C)Oc1c2c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.317
CB1 binding score: -15.763
InChIKey:ASFYFCIQANICBM-UHFFFAOYSA-N
ID: 31368
SMILES:C(C=C(C)C)CC(C)=CCc1c(C)c(=O)c(O)cc(C2C(C(C)C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -14.915
InChIKey:JJMDSLNGGRVEMK-UHFFFAOYSA-N
ID: 31369
SMILES:C(=CCC)Cc1c(O)cc2c(c1O)C1C(C(C)(C)O2)CCC(COC)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.432
InChIKey:XXEPJCAQDODZML-UHFFFAOYSA-N
ID: 31370
SMILES:C(C)(C)(C)CC(NCC(N1C(=O)c2cc(O)c3c(c21)OC(C)(C)C1CCC(C)=CC31)O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.627
CB1 binding score: -15.788
InChIKey:GENFYPXOICJQLW-UHFFFAOYSA-N
ID: 31371
SMILES:c12c3c(O)cc(C)c1C(=O)OC(C)(CCC=C(C)C)C=CC(C)=CCC2C3(C)CC=CC(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -15.63
InChIKey:VFXLPXNBWXLOMC-UHFFFAOYSA-N
ID: 31372
SMILES:C(C)(C(Cc1c2c(cc(C)c1O)OC(C)(C)C1CCC(O)(C)C(O)C12)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.317
InChIKey:IFKBDVDEEAGHHO-UHFFFAOYSA-N
ID: 31373
SMILES:C1(C(C)=C)C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 31374
SMILES:C(=C(C)C)CCC1(C)C2Cc3c(cc(CCc4ccccc4)cc3O)OC2(C)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -11.745
InChIKey:MWJWNFSQAIIVBS-UHFFFAOYSA-N