ID: 109936
SMILES:O=C(C)Oc1cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.989
InChIKey:ZTZGBEZKXBIYDU-UHFFFAOYSA-N
ID: 109937
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.56
InChIKey:VBPOXSBFZQHISD-UHFFFAOYSA-N
ID: 109938
SMILES:C1(C)C(CC(c2c(O)cc(CCCCC)cc2O)=O)(C)C(C)(C)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.619
InChIKey:JSSSNJMUUQNUOE-UHFFFAOYSA-N
ID: 109939
SMILES:c1(CC=C(C)C)c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 109940
SMILES:CC(C)c1cc2c(cc1O)CC1OC13C(C(C)(C)O2)CC=C3C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.288
InChIKey:SPOUBSVWQDAQTD-UHFFFAOYSA-N
ID: 109941
SMILES:C(c1cc(O)c2c(c1O)C=CC(CCC=C(C)C)(C)O2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.619
InChIKey:ADXDOXHSRNCOQZ-UHFFFAOYSA-N
ID: 109942
SMILES:c1(CC(=O)C)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.33
InChIKey:FTVPPOZRTMQXMB-UHFFFAOYSA-N
ID: 109943
SMILES:C1(C(C)(C)O)CC(OC(=O)C)C(=C)C2Cc3c(c(O)c(CC)cc3Oc3cc(CCCCC)cc(O)c3C2CC(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 592.817
CB1 binding score: -15.438
InChIKey:FFERYLTWLMOOKI-UHFFFAOYSA-N
ID: 109944
SMILES:C1C(=O)CC(C)C2(C1(C)C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.629
InChIKey:OASJNMBQPCWEQA-UHFFFAOYSA-N
ID: 109945
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 109946
SMILES:OCC(=CC=CC(O)(C)C)C1C(c2cc(O)c(O)cc2O)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.96
InChIKey:CCPFYMAQHZZLCT-UHFFFAOYSA-N
ID: 109947
SMILES:C(=O)(c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -18.068
InChIKey:CPZWKXRSBORARS-UHFFFAOYSA-N
ID: 109948
SMILES:Oc1cc(O)cc(C)c1C1C(C(C)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 109949
SMILES:Oc1c(O)c2c(c(OC)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -18.036
InChIKey:QLMKMOAHVOOUSU-UHFFFAOYSA-N
ID: 109950
SMILES:O=C(C1=C(O)C(=CC(=O)C)c2c(O)cc(CCC)cc2OC1(C)CCC=C(C)C)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -13.866
InChIKey:XITCBAUWXHJDDG-UHFFFAOYSA-N
ID: 109951
SMILES:c1c2c(cc(C)c1CCCC)OC(C)(C)C(OC(C)=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.222
InChIKey:UXYJFHZEPMOTJM-UHFFFAOYSA-N
ID: 109952
SMILES:c1(O)cc(CCC)cc2c1C1C(C)(C)OC3(C)CCC(C(C(C=CC(C)C)=O)=CC13)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -14.109
InChIKey:XEXOAKYPDUSRER-UHFFFAOYSA-N
ID: 109953
SMILES:CC(C)C1CCC(COCl)=CC1c1cc(CCCCC)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 350.93
CB1 binding score: -11.707
InChIKey:MQDZFFXEFBDOLE-UHFFFAOYSA-N
ID: 109954
SMILES:C(C(C)=CCc1c(O)cc(CCCCC)cc1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 109955
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 109956
SMILES:C1(C)=CCC2C(C)(C)Oc3cc(CCCCC)oc3CC2=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.519
InChIKey:JJFNONHMVCFALF-UHFFFAOYSA-N