ID: 114934
SMILES:C1C=C(C)CC2C1C(C)(C)Oc1c2ccc(COC(CC)=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.145
InChIKey:TXKXSNWYGSJGRF-UHFFFAOYSA-N
ID: 114935
SMILES:Oc1c(C)cc(O)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.202
InChIKey:POKKMVCKYNIHIO-UHFFFAOYSA-N
ID: 114936
SMILES:C12(OC(C)(C)CC1)C(C)Cc1c(O)c(C(=O)C3(C)CC4C(C)(C)OC(=O)C4C(C)=C3)c(O)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.589
CB1 binding score: -16.795
InChIKey:VVADKRZIJKBSMF-UHFFFAOYSA-N
ID: 114937
SMILES:CC1(C)C2C(c3c(cc(CCCCC)cc3OC)OC(C)(C)C2=O)C(C(OCC)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.46
InChIKey:CJQZERKSYUCQQO-UHFFFAOYSA-N
ID: 114938
SMILES:c12c(cc(CCCCC)cc1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 114939
SMILES:C(CCCC)c1cc(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
ID: 114940
SMILES:CCOCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(COC)(O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -15.251
InChIKey:RERMZJDFKNCWBO-UHFFFAOYSA-N
ID: 114941
SMILES:C(C)(=CCCC(C1CCC(C)(CCC2(C)C=Cc3c(O)cc(CCCCC)cc3O2)O1)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -14.567
InChIKey:VZCJSGNEQOUYJM-UHFFFAOYSA-N
ID: 114942
SMILES:Oc1c2c(cc(CCCCC)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
ID: 114943
SMILES:c1c(OCC)c(C(=O)OC)c(O)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -13.096
InChIKey:YCHOXGYMJPYLMV-UHFFFAOYSA-N
ID: 114944
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2OC)CC(C)CC1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.528
CB1 binding score: -18.883
InChIKey:KKBNGEMFBFEYQN-UHFFFAOYSA-N
ID: 114945
SMILES:c12cc(CCCCC)cc(O)c1C=CC(C(=C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -15.78
InChIKey:OUCQSEJOCAMCIA-UHFFFAOYSA-N
ID: 114946
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C(C(=C)C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.265
InChIKey:HZBBQDWEXFTDKO-UHFFFAOYSA-N
ID: 114947
SMILES:O(C(=O)C)C1C2(C)C3(C(C)C(=O)C1)Oc1c(CCCCC)cc(O)c(c31)CCC(C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -13.886
InChIKey:KDJCCDIUKYYDOE-UHFFFAOYSA-N
ID: 114948
SMILES:C1(=O)C(CO)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.202
InChIKey:OZRSMBLYKRSVAS-UHFFFAOYSA-N
ID: 114949
SMILES:c1(O)c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 114950
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 114951
SMILES:CC(C)(O)C1Oc2c(c(O)cc(C)c2)C(CCC(=O)O)C1CCC(C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.438
CB1 binding score: -14.135
InChIKey:SIVSGNMOOWVZCW-UHFFFAOYSA-N
ID: 114952
SMILES:C12(CC(=O)C(C)=CC1C=C(C)C)C(=O)c1c(O)cc(CCC)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -13.401
InChIKey:OXEKGZCUXVUGCP-UHFFFAOYSA-N
ID: 114953
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1CC(C)=CCC1(C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -16.251
InChIKey:ZSWLCBKBSBBKOR-UHFFFAOYSA-N
ID: 114954
SMILES:C(C)(C)C1CCC(C)(O)C2Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.961
InChIKey:CNKSTABSFLNANJ-UHFFFAOYSA-N