ID: 113611
SMILES:C1C(C)=CCCC2(C)OC2CCC(C)C1c1c(OC(C)=O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: Not available
InChIKey:KZVJBAPJCPEQOD-UHFFFAOYSA-N
ID: 113612
SMILES:C1C(CCCCCC)=C(C)C(c2c(O)cc(C)cc2O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -13.279
InChIKey:DOKUVHGTHGZAOO-UHFFFAOYSA-N
ID: 113613
SMILES:OCC1(C)C2CC=C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.979
InChIKey:BGFAVKWESQHCHC-UHFFFAOYSA-N
ID: 113614
SMILES:CC(C)=CC1CC(=CCCC(=CCc2c(O)cc(CCCCC)cc2O)C)C(=C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -14.599
InChIKey:PFBZQWLSMNRCGZ-UHFFFAOYSA-N
ID: 113615
SMILES:C1(O)Cc2c(cc3c(c2OC)OCO3)C2C1C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.482
CB1 binding score: -11.984
InChIKey:BDPLVYUFMQVFCA-UHFFFAOYSA-N
ID: 113616
SMILES:O(c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c(CCC(CC)O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.178
InChIKey:IMYTVVTZUKWEPU-UHFFFAOYSA-N
ID: 113617
SMILES:Oc1cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 113618
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.957
InChIKey:BXBPYYDKENEJGP-UHFFFAOYSA-N
ID: 113619
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 113620
SMILES:C1(C)CCc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -17.812
InChIKey:MGEGNKXUIQHAJB-UHFFFAOYSA-N
ID: 113621
SMILES:CC(C)(C12C(=O)C=C(C)C(O)C1)c1c(c(OC)cc(CCCCC)c1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.605
InChIKey:SYQZKPWPDBFWNT-UHFFFAOYSA-N
ID: 113622
SMILES:c12c(O)cc(CCC)c(O)c1C1C(C(C)(C)O2)CCC(O)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -13.646
InChIKey:KBLIYAZBZQLOON-UHFFFAOYSA-N
ID: 113623
SMILES:CC1(C)C2C(C)(C=CC1=O)Oc1cc(CCCCC)ccc1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.815
InChIKey:MGGABMAWNKPZOI-UHFFFAOYSA-N
ID: 113624
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)=CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.103
InChIKey:YPQLZKKAWUFMFC-UHFFFAOYSA-N
ID: 113625
SMILES:C1(CCCC)=C(C)C(=O)OC(C)(CCC=C(C)C)C1Cc1c(O)ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: Not available
InChIKey:LXLWVGDUQIGRNS-UHFFFAOYSA-N
ID: 113626
SMILES:O1C2C(C(=C)C1=O)C1c3c(cc(C)c(O)c3C(=O)C2C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.515
CB1 binding score: -16.141
InChIKey:WHZNYBYOQZHVJJ-UHFFFAOYSA-N
ID: 113627
SMILES:O=C(Cc1c(O)cc2c(c1O)C1C(CC=C(C)C1)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.704
InChIKey:SHUGKLJVFUXYMR-UHFFFAOYSA-N
ID: 113628
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)(O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 113629
SMILES:C1(C)C2C(C(=O)C1C(C)C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -8.314
InChIKey:MEWMUVRDXVVDDR-UHFFFAOYSA-N
ID: 113630
SMILES:C(Cc1cc(O)c(CC=C(C)C)c(O)c1)CC=C(C)CCC(NO)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 375.553
CB1 binding score: -14.395
InChIKey:NGWUPTKSTFCBGE-UHFFFAOYSA-N
ID: 113631
SMILES:CC(=C)C1CC(=O)C2(C)Oc3c(c(O)cc(CCCCC)c3)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.667
InChIKey:YNQWRMNOTBEDAJ-UHFFFAOYSA-N