ID: 60313
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 60314
SMILES:c1c(C(C(O)CO)O)cc(O)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -16.376
InChIKey:ILQAMDCOUWNNOL-UHFFFAOYSA-N
ID: 60315
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(=O)C(C)(C)OC1(CC=C(CCC=C(C(=O)O)CO)C)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.605
CB1 binding score: -17.018
InChIKey:BNWGMJMTQVJNAH-UHFFFAOYSA-N
ID: 60316
SMILES:C1(=O)c2c(C3C(C(C)C)CCC(C)=C3)c(O)cc(CC3C(C)(C)C(C(C)C)=C(O)C3=O)c2OC(C)(C)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.698
CB1 binding score: Not available
InChIKey:LDYQJAJOYVSPJX-UHFFFAOYSA-N
ID: 60317
SMILES:c1(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.957
InChIKey:ZSBGNUPOFUYDMQ-UHFFFAOYSA-N
ID: 60318
SMILES:Oc1c(C(CC(C)C)=O)c2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.831
InChIKey:YHIVFUIEZCDTGJ-UHFFFAOYSA-N
ID: 60319
SMILES:C1(C)C2Oc3c(c(O)cc(C)c3C=O)C(C2C(O)(C)C)C2(C)C(C)CCC3(C)C1C3C(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -15.627
InChIKey:OBMGNSQGHIFTQY-UHFFFAOYSA-N
ID: 60320
SMILES:C12C(OC(C3c4cc(C(OC)=O)c(O)c(OC)c4Oc4cc(CCCCC)cc(O)c43)=CC1(C)C)OC(C)(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 566.647
CB1 binding score: -15.677
InChIKey:SSLGCJPNKGPHGC-UHFFFAOYSA-N
ID: 60321
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.296
InChIKey:FZAGTOJLWTUWJG-UHFFFAOYSA-N
ID: 60322
SMILES:c1(O)cc(CCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 60323
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 60324
SMILES:C(C)(=CCCC(=CCc1cc(O)c(C)cc1OC(C)=O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -19.332
InChIKey:HAXRQCRJABYNJC-UHFFFAOYSA-N
ID: 60325
SMILES:CC1(C)C(C(CC2(C)OC(=O)CC2)C)C2(c3c(ccc(O)c3)OC2(C)C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.929
InChIKey:OHKMIHPLBWEZBQ-UHFFFAOYSA-N
ID: 60326
SMILES:CC1(C)Oc2c(c(O)cc(Br)c2)CC2C(C)(O2)CCC2(O)C1C(O)CC2(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 457.361
CB1 binding score: -12.449
InChIKey:BHLBDBCHXMXJEE-UHFFFAOYSA-N
ID: 60327
SMILES:C12C(C)(CCC1C(C)C)C1CCC2(C)Oc2c(c(O)c(C(=O)O)c(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.518
InChIKey:AXLJNUMORWRQBS-UHFFFAOYSA-N
ID: 60328
SMILES:CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C2(O)C1=C(C(CC(C(C(CCc1cc(OC)c(OC)c(OC)c1)CC=C(C)C)C)C(=CC)C)C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 731.071
CB1 binding score: -15.258
InChIKey:RAIBEYUALGYAIE-UHFFFAOYSA-N
ID: 60329
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 60330
SMILES:O(C)c1c(C2C=C(C=C)CCC2C(=C)C)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.939
InChIKey:IKWATODDURTSPM-UHFFFAOYSA-N
ID: 60331
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.712
InChIKey:OBXUHTSWUPLSDQ-UHFFFAOYSA-N
ID: 60332
SMILES:c1(O)c(Cc2ccc(C(C)C)c(O)c2)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -8.873
InChIKey:XSJCYBXKGJRRPY-UHFFFAOYSA-N
ID: 60333
SMILES:C(C(OCCc1ccc(O)c(O)c1)=O)=C1CCC(CC=CC(C)(O)C)(C)C1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.929
InChIKey:YBOYYBOBIQUBMX-UHFFFAOYSA-N