ID: 49015
SMILES:CC(C1CCC(C)(C)C1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -16.793
InChIKey:LIQULMNBELGKPQ-UHFFFAOYSA-N
ID: 49016
SMILES:C1(C)(C)C2C(O)C3c4c(cc(CCCCC)cc4O)OC3C1(O)C(OC(c1ccc(O)cc1)=O)C21OC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.583
CB1 binding score: -14.216
InChIKey:HYCSLIWDIRRZPO-UHFFFAOYSA-N
ID: 49017
SMILES:Cc1c(C(OC(=O)CC)CC(C)C)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC(OC)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -15.633
InChIKey:DBTGOPFSIJIIHB-UHFFFAOYSA-N
ID: 49018
SMILES:O1c2c3c(cc(CCC(C(C)=C)CCC(O)(C=C)C)c3O)OC(C)(C)C(O)CCC2C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -13.951
InChIKey:SUKRZEWFHSQVHK-UHFFFAOYSA-N
ID: 49019
SMILES:C1CCC(C)=C2c3c(O)cc(CCCCC)cc3OC12C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.767
InChIKey:DQMJFRGUCMBZPO-UHFFFAOYSA-N
ID: 49020
SMILES:CC(C12CC3C(C)(Oc4c(c(O)cc(CCCCC)c4)C3)CC1C(C)(O)C(=O)C2)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -11.984
InChIKey:UFIIVSZPCYEFKK-UHFFFAOYSA-N
ID: 49021
SMILES:C(O)C1C(C)CC(c2c(O)cc(CCCCC)cc2OC)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.445
CB1 binding score: -14.969
InChIKey:DZMKKQZJOKZMEH-UHFFFAOYSA-N
ID: 49022
SMILES:CC(CCc1c(O)cc(CCCCC)cc1O)=CC=CC(C)=CC(C(=O)OC)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.454
InChIKey:OMGZIVVJBIWBNW-UHFFFAOYSA-N
ID: 49023
SMILES:C(Cc1c(O)c2c(c(C(=O)O)c1)OC(C)(C)C1CC=C(C)CC12)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -19.435
InChIKey:MHISYFCZIMJXTB-UHFFFAOYSA-N
ID: 49024
SMILES:C1(=O)C2(C)Oc3c(c(O)cc(CCCCC)c3)C3C(C(C)(C)Oc4c3c(O)cc(CCCCC)c4)C2C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 560.775
CB1 binding score: -12.986
InChIKey:ZUDZKTQXXSKDQQ-UHFFFAOYSA-N
ID: 49025
SMILES:c1(CCCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.784
InChIKey:QPUHYZGLKQWEKI-UHFFFAOYSA-N
ID: 49026
SMILES:CC1=CCC(C(=C)C)CC1c1c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.388
InChIKey:CLUYRZPIFPWAEP-UHFFFAOYSA-N
ID: 49027
SMILES:C1C2C(c3c(cc(CCCCC)cc3O)OC2)C(C)(C)C(O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -12.299
InChIKey:ZODZCOUNFYYCPJ-UHFFFAOYSA-N
ID: 49028
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)-c3c(O)c(C)cc(O)c3C1C=C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.667
CB1 binding score: -16.168
InChIKey:NGPARQRKEVAPCT-UHFFFAOYSA-N
ID: 49029
SMILES:O(C(=O)C)c1cc2c(c(C(=O)C)c1C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.571
InChIKey:MHKAMQPOPCOSKO-UHFFFAOYSA-N
ID: 49030
SMILES:CC1(C)C(=O)C(O)CC2c3c(cc(CCCCC)cc3O)CC(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.262
InChIKey:JIOXHUMDXOUBTE-UHFFFAOYSA-N
ID: 49031
SMILES:c1(-c2c3c(c(C)cc2O)OC(CCC=C(C)C)(C)C(O)C3)cc(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -16.894
InChIKey:WWNVAGCDVWPSGX-UHFFFAOYSA-N
ID: 49032
SMILES:COc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC3(C)C(O)CCC1(OC3)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -13.342
InChIKey:OPKKSVJXYBRUGW-UHFFFAOYSA-N
ID: 49033
SMILES:c1c(O)c(CC=C(CCC=C(C)C)C)c(O)cc1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.27
InChIKey:PBVXSNIWCHRXCN-UHFFFAOYSA-N
ID: 49034
SMILES:C(c1c(OC)ccc(O)c1)CCCN1CC2C(=O)C=C(C)C2C12CC=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 395.543
CB1 binding score: -14.824
InChIKey:UDRSMSYTRSFBPN-UHFFFAOYSA-N
ID: 49035
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N