ID: 121675
SMILES:C1(C)CCC2(O)C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.134
InChIKey:YSYVJOJPHMLSBY-UHFFFAOYSA-N
ID: 121676
SMILES:CCC1C2c3c(cc(CCCCC)cc3O1)C(C(=O)OC)(O)C1C(C)(C)C1CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -13.53
InChIKey:UJJJAVBEXKYWCW-UHFFFAOYSA-N
ID: 121677
SMILES:C12C(C3C(C)CCC3C3(COC1=O)Oc1cc(CCCCC)cc(O)c1C3C(C)(C=O)CCC1C(C)(C)OC(=O)CC1)C2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.8
CB1 binding score: -13.971
InChIKey:XEXMUUZJJWSJMA-UHFFFAOYSA-N
ID: 121678
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCCO)cc1OC(C)=O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.533
InChIKey:QKZBLHVSOYYDCZ-UHFFFAOYSA-N
ID: 121679
SMILES:C1(C)(C)C2CCC(C)CC2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.987
InChIKey:QYNCMPYNYFYQFE-UHFFFAOYSA-N
ID: 121680
SMILES:C1(C)C(=O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.046
InChIKey:UECUNLJHUBNWSC-UHFFFAOYSA-N
ID: 121681
SMILES:CC(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 121682
SMILES:C12c3c(cc(O)cc3O)OC(C)(C)C1CCC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.284
InChIKey:JIQMEMDNHUCIPK-UHFFFAOYSA-N
ID: 121683
SMILES:Oc1cc(CC=C(C)C)c2c3c1C(O)C(CO)=CC3C(CCC(C)=C)(C)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.02
InChIKey:YSHFQKLVCSSPRO-UHFFFAOYSA-N
ID: 121684
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C(=O)O)=CC12)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.017
InChIKey:KXZCQGGEXNXHAU-UHFFFAOYSA-N
ID: 121685
SMILES:c1(C2C=C(C)CCC2C(=C)C)c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 121686
SMILES:c12c(O)cc(CCCCC)cc1OC(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: 121687
SMILES:CC(Cc1cc(C)cc2c1C1CC(C)=CCC1C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -13.574
InChIKey:ZZQWFOGAEORWQH-UHFFFAOYSA-N
ID: 121688
SMILES:O1C23Oc4c(c(O)cc(CCCCC)c4)C2CC(C1(C)C)CC3C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.47
InChIKey:HPATXFZXHNLVTM-UHFFFAOYSA-N
ID: 121689
SMILES:C12C(C(=O)O)CCC(C(C)=C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.367
InChIKey:RRISKHWAZOEORL-UHFFFAOYSA-N
ID: 121690
SMILES:C1(=O)c2c(cc(CCCCC)cc2O)OC(C)(C)C2CCC(C)=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.912
InChIKey:ICKLEZDNADXJLW-UHFFFAOYSA-N
ID: 121691
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 121692
SMILES:C(C)(C)=CCCC(CO)=CCc1cc(C(=O)O)c(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.177
InChIKey:HYOIXHCCRITHCG-UHFFFAOYSA-N
ID: 121693
SMILES:O(c1cc(CCCCC)cc2c1C1C(CC=C(C)C1O)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.027
InChIKey:BJDDEBBYIXPOTQ-UHFFFAOYSA-N
ID: 121694
SMILES:C(C(=CCCC1=CC(c2cc(OC)cc(C)c2O)CC1)C)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.811
InChIKey:UNOTYBYGYDUPLL-UHFFFAOYSA-N
ID: 121695
SMILES:C1C(C(C)=C)CCC2(C)Oc3c(c(O)cc(C(C)C(CC)C)c3)C2CC=C(CCC=C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -15.116
InChIKey:CGLCDTKRINFBCX-UHFFFAOYSA-N