ID: 85849
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 85850
SMILES:C(Cc1cc(O)c(CC=C(CCCC(C)C)C)c(O)c1)C1(C)CCCSC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.687
CB1 binding score: -14.399
InChIKey:FLOUDGLVSYHQMR-UHFFFAOYSA-N
ID: 85851
SMILES:C1C2(C)CCCC(C)C2(C)Oc2c(c(O)cc(CCCCC)c2)-1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.841
InChIKey:IRBAGOZBCKOZQV-UHFFFAOYSA-N
ID: 85852
SMILES:Oc1c(O)c2c(cc1OC)C1C(C(C)(C)O2)CC(=O)C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -16.034
InChIKey:OHDSBVUBDWQEBS-UHFFFAOYSA-N
ID: 85853
SMILES:CC(=C)C1C(c2c(O)cc(CCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.748
InChIKey:ORIYPICUSOGUOA-UHFFFAOYSA-N
ID: 85854
SMILES:C(CCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(-c2ccc3c(c4ccccc4[nH]3)c(=O)c2)c1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 559.794
CB1 binding score: -15.706
InChIKey:XUEGUZTWIFYGOG-UHFFFAOYSA-N
ID: 85855
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 85856
SMILES:Oc1c(O)c(CC=C(C)CCC=C(C)C)c(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.231
InChIKey:XXLHKDZCWXIZBZ-UHFFFAOYSA-N
ID: 85857
SMILES:CC1(C)Oc2c(c(O)cc(CCc3ccc(O)cc3)c2)C2CC(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -18.615
InChIKey:HMAKUWMOXJJDNS-UHFFFAOYSA-N
ID: 85858
SMILES:Oc1cc(CCC)c(O)c2c1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.536
InChIKey:JTTTZOVLJRAQOU-UHFFFAOYSA-N
ID: 85859
SMILES:C=C(C1C(C(C)C)Oc2cc(CCCCC)cc(O)c21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.257
InChIKey:RISKWVKCKYLLKV-UHFFFAOYSA-N
ID: 85860
SMILES:C1(C)(C)Oc2c(cc(O)cc2)C2C=C(CO)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -20.48
InChIKey:YHVSUBRHUHWIPQ-UHFFFAOYSA-N
ID: 85861
SMILES:c1(CC2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.123
InChIKey:UOQLTQOQOKFCFU-UHFFFAOYSA-N
ID: 85862
SMILES:CC(=CCc1c(O)c(C(=O)O)cc(CCCCC)c1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 344.495
CB1 binding score: -19.654
InChIKey:TURBAOCYHPEVOM-UHFFFAOYSA-N
ID: 85863
SMILES:CC1(C)CCCC23CCC(C)(O1)C2Oc1cc(CCCCC)cc(O)c13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.111
InChIKey:JOOXYWKNRZVWHE-UHFFFAOYSA-N
ID: 85864
SMILES:C1(CC(C)=CCc2c(O)c(C)cc(OC)c2)=C(C)CCCC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.432
InChIKey:VKJXUZKHXCAUEW-UHFFFAOYSA-N
ID: 85865
SMILES:CC1=CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.43
InChIKey:VSXQHHDKZULYQM-UHFFFAOYSA-N
ID: 85866
SMILES:C(CC)Cc1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.935
InChIKey:WQWOLTTULXLSHU-UHFFFAOYSA-N
ID: 85867
SMILES:COc1c2c(c3c(O)cc(CC=C)cc3c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -15.892
InChIKey:RPJSKCJBVPHFLQ-UHFFFAOYSA-N
ID: 85868
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 85869
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N