ID: 62581
SMILES:C12(C)CCCC1C(C)(C)Oc1c(cc(C(=O)C(CC)C)cc1O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -11.409
InChIKey:LVJDUZSMPKUIPL-UHFFFAOYSA-N
ID: 62582
SMILES:C1(CCCC(=C)C)(C)Oc2cc(CCCCC)cc(O)c2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.127
InChIKey:VERLVPWHTKBPCN-UHFFFAOYSA-N
ID: 62583
SMILES:o1c(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.346
InChIKey:SAUXKDLKKADDDO-UHFFFAOYSA-N
ID: 62584
SMILES:c1c(C)c(O)cc2c1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -17.792
InChIKey:OVLCNLKQINIQNN-UHFFFAOYSA-N
ID: 62585
SMILES:C(CCCc1cc2c(cc1)C(=O)OC(C)C(C)(C)O2)C(C)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.562
InChIKey:BCQGKUKIQZVYNH-UHFFFAOYSA-N
ID: 62586
SMILES:C(=C(CCC=C(C)CCC=C(C)C)C)Cc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 62587
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(C)cc(c32)C=C(C)C(=O)C=CC(C)=C)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -14.328
InChIKey:QDDUTLWCQQCWPK-UHFFFAOYSA-N
ID: 62588
SMILES:C1=C(CO)CCC(C(C)=C)C1c1c(O)cc(C)c(I)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.257
CB1 binding score: -15.27
InChIKey:BUOGBQFYULUIJV-UHFFFAOYSA-N
ID: 62589
SMILES:COc1cc2c(cc1C)OC1(C)C3C2OC(C1(C)CCC(OC(C)=O)C(C)(C)O)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -14.679
InChIKey:KRTYKAXSISPAEQ-UHFFFAOYSA-N
ID: 62590
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -19.296
InChIKey:GEMPDHCIWOATES-UHFFFAOYSA-N
ID: 62591
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 62592
SMILES:C1(C(C)C)C(c2c(O)c(C(=O)CCCCC)cc3c2OC(C)(C)C=C3)CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.309
InChIKey:FEXZVJKHMJTWNU-UHFFFAOYSA-N
ID: 62593
SMILES:CC(=CCc1c(O)cc(CCCCC[N+](C)(C)C=C)cc1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.482
CB1 binding score: -14.605
InChIKey:ASGCHCWKAZNTBW-UHFFFAOYSA-O
ID: 62594
SMILES:C1(C)=CC2c3c(cc(C)c(O)c3)OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N
ID: 62595
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 62596
SMILES:CC(C)=CCCC(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 62597
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1(C)CCC(C(C)C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.292
InChIKey:HDZMXMXUMOWVTE-UHFFFAOYSA-N
ID: 62598
SMILES:CC1(C)Oc2c(c(O)cc(CC=C)c2)C2CC1CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -16.502
InChIKey:TZUSDVLJUIJZQD-UHFFFAOYSA-N
ID: 62599
SMILES:C1(C(=O)O)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 62600
SMILES:C1(C)(C)Oc2c(cc(C)c(CCC(CC)O)c2)C2C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.76
InChIKey:ZMDYUBIKASVDHB-UHFFFAOYSA-N
ID: 62601
SMILES:Oc1c2c(cc(CCCCC)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N