ID: 56029
SMILES:C(C1(C)C=C(C)C(c2c(O)cc(CCCCC)cc2)C=C(C)CCC1C(=C)C)=CC(=CC(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.773
CB1 binding score: -16.391
InChIKey:NWYAIFZPVHXLSS-UHFFFAOYSA-N
ID: 56030
SMILES:C1(c2c(O)cc(CCCCC)cc2)C(O)=C(C)C(=O)C2(CC(C)=CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.05
InChIKey:JCGOCWSOKGYCGE-UHFFFAOYSA-N
ID: 56031
SMILES:C(C)(=CCc1cc(O)c2c3c1C1CC(C)=CCC1C(C)(C)O3)CC(CC=C(C)C)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.664
CB1 binding score: -12.786
InChIKey:YYVLIDLNBCNLRT-UHFFFAOYSA-N
ID: 56032
SMILES:C1=C(CCC=C(C)C)C(O)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.966
InChIKey:ZXVASBAVBSPELS-UHFFFAOYSA-N
ID: 56033
SMILES:C1(C)C(=O)OC(c2c(O)cc(CCCCC)cc2O)CC(C)=CCCC2=CC1OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -13.905
InChIKey:PMOZQQIQYIHVAE-UHFFFAOYSA-N
ID: 56034
SMILES:C1CC2(C)c3c(O)cc(CCCCC)cc3OC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.74
InChIKey:QBLAOYHKJMBDNZ-UHFFFAOYSA-N
ID: 56035
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)(O)CO)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.211
InChIKey:IFVIOJVZRCYUQV-UHFFFAOYSA-N
ID: 56036
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 56037
SMILES:C1C(C(C)C)C(c2cc(CC=C(C)CCC=C(C)C)ccc2O)OC(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.769
InChIKey:BLAGETIYSKYBME-UHFFFAOYSA-N
ID: 56038
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(=C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.78
InChIKey:NROBKQHQUVSAAS-UHFFFAOYSA-N
ID: 56039
SMILES:Oc1c(C(O)=O)c2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -15.929
InChIKey:QUVZHABNVUYDDK-UHFFFAOYSA-N
ID: 56040
SMILES:C(C)(C)=CCCC1(C)Oc2cc(CCCCCOCC=C)cc(O)c2C2C=CC3C(=C)CCC123
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -16.813
InChIKey:PKWAPTKJHDUNIK-UHFFFAOYSA-N
ID: 56041
SMILES:Oc1c(C(C=CC(C)(C)O)=O)cc(CC=C(C)CCC=C(C)C)c(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.74
InChIKey:IOPUEWLJZLMPFC-UHFFFAOYSA-N
ID: 56042
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)c(C(=O)O)c(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.521
InChIKey:IQSYWEWTWDEVNO-UHFFFAOYSA-N
ID: 56043
SMILES:Oc1c(CC(O)C)c2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.519
InChIKey:WVHBGXRJVZFLSK-UHFFFAOYSA-N
ID: 56044
SMILES:c1(C(O)=O)c(O)cc(O)c2c1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -15.929
InChIKey:QUVZHABNVUYDDK-UHFFFAOYSA-N
ID: 56045
SMILES:C1(OC(=O)C)C(OC(=O)C)C2(C)CCC3(C)CCC(O)(C(C)C)C3C(c3c(cc(CCCCC)cc3O)O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.701
CB1 binding score: -15.695
InChIKey:DBXQPUGYYOSUSN-UHFFFAOYSA-N
ID: 56046
SMILES:Cc1c(O)c(C(=O)C(CC)C)cc2c1C1C(C(C)(C)O2)CC(=O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.213
InChIKey:GDEGGXDSXGCJHW-UHFFFAOYSA-N
ID: 56047
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.469
CB1 binding score: -16.146
InChIKey:UGFAENRHJIKCCC-UHFFFAOYSA-N
ID: 56048
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(CO)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.401
InChIKey:IQFBDTWPFXQKNC-UHFFFAOYSA-N
ID: 56049
SMILES:C1(C)=CC(c2c(O)cc(O)cc2C)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N