ID: 99793
SMILES:CC1(c2c(-c3cc([N+](=O)O)ccc3)cc(CCCCC)cc2O)CCC(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.605
CB1 binding score: -15.24
InChIKey:PPONJJVXHNRGMS-UHFFFAOYSA-O
ID: 99794
SMILES:C(C)(CCC=C(C)C)C1CCC(C)=C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -14.692
InChIKey:PLHVAKCQVAVLKX-UHFFFAOYSA-N
ID: 99795
SMILES:C(C(O)COCc1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1)Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 437.02
CB1 binding score: -13.617
InChIKey:GXRPIGVRDNKEKQ-UHFFFAOYSA-N
ID: 99796
SMILES:C12C(CC=C(C)C1)C(C)(C)Oc1c2c(O)cc(CCCCC=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.713
InChIKey:FVBMRYKTGOGJBS-UHFFFAOYSA-N
ID: 99797
SMILES:CC1(C)Oc2c(c(O)cc(C)c2)C2C3CCC(C(=O)C)C21C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -11.135
InChIKey:GYUYYGOCUICKPN-UHFFFAOYSA-N
ID: 99798
SMILES:c1(O)cc(OC)c2c(c1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.232
InChIKey:MGYSLLUUKPTDIP-UHFFFAOYSA-N
ID: 99799
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C=C(CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.907
InChIKey:RKMSKMCBCVDOMN-UHFFFAOYSA-N
ID: 99800
SMILES:CC(C)C1C=CC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.216
InChIKey:AOOBOQLXJOFYIO-UHFFFAOYSA-N
ID: 99801
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -18.58
InChIKey:QSWUPWBGGAGFKI-UHFFFAOYSA-N
ID: 99802
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C1(C)CCC1C(C)(C)CCCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -17.662
InChIKey:LVDOCXVOEIPWBZ-UHFFFAOYSA-N
ID: 99803
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 99804
SMILES:c1c(CCCCC)cc2c(c1O)C1(C(=O)C(OCC)C(C)(C=C)C1)OC(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.042
InChIKey:OUUTUAZKXOFHNB-UHFFFAOYSA-N
ID: 99805
SMILES:C1c2c(O)cc(CCCCC)cc2OC(C(C2C(C)C(C)C(O)C2)=O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.119
InChIKey:CNIGOKOPSBTBRU-UHFFFAOYSA-N
ID: 99806
SMILES:c1(-c2oc(=O)c3c(c2)OC(C)(C)C2C3C=C(CCC=C(C)C)C(O)C2)ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.522
CB1 binding score: -17.162
InChIKey:ARGYTHFSIQHRMX-UHFFFAOYSA-N
ID: 99807
SMILES:Oc1cc(CCCCC)cc(O)c1C1C(C(CO)C)CC(C)(O)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.499
CB1 binding score: -14.037
InChIKey:YRBIMMAQYUWRMX-UHFFFAOYSA-N
ID: 99808
SMILES:CC(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 99809
SMILES:c1(CC)cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 342.523
CB1 binding score: -18.238
InChIKey:JDHVKMUCXDUDSU-UHFFFAOYSA-N
ID: 99810
SMILES:C12(c3c(cc(CCCCC)c(C(=O)O)c3O)OC1(C)C)CC(C)C1C2C2=C(C)C(=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -13.46
InChIKey:CYPQHFMSHZZTAQ-UHFFFAOYSA-N
ID: 99811
SMILES:c1(O)cc(CCCCC)c2c(c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.505
InChIKey:VVJFDCTUCNOICO-UHFFFAOYSA-N
ID: 99812
SMILES:c1(CCCCC)cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.847
InChIKey:PBHSKWUIWPWYKU-UHFFFAOYSA-N
ID: 99813
SMILES:O(CCOCBr)C(COc1c2c(cc(C)c1)OC(C)(C)C1CCC(C)CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 455.389
CB1 binding score: -14.324
InChIKey:YNFQRFIJVSFUDA-UHFFFAOYSA-N